# generated using pymatgen data_Zr2Nb(ReSi)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.91409317 _cell_length_b 6.91409216 _cell_length_c 3.38655936 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.52379894 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2Nb(ReSi)3 _chemical_formula_sum 'Zr2 Nb1 Re3 Si3' _cell_volume 140.87169787 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Zr Zr0 1 0.40365767 0.00187269 0.50000000 1.0 Zr Zr1 1 0.00187269 0.40365767 0.50000000 1.0 Nb Nb2 1 0.59680659 0.59680659 0.50000000 1.0 Re Re3 1 0.74478045 0.99640180 0.00000000 1.0 Re Re4 1 0.99640180 0.74478045 0.00000000 1.0 Re Re5 1 0.25440156 0.25440156 0.00000000 1.0 Si Si6 1 0.33909381 0.66583853 0.00000000 1.0 Si Si7 1 0.66583853 0.33909381 0.00000000 1.0 Si Si8 1 0.99714690 0.99714690 0.50000000 1.0